Vitas-M small molecule compound
3-[4-(difluoromethyl)-2-methyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]-N-[1-(4-methylbenzyl)-1H-1,2,4-triazol-3-yl]propanamide
Catalog ID
STL400811
SMILES O=C(Nc1ncn(n1)Cc1ccc(cc1)C)CCn1c(=O)cc(c2c1nn(c2)C)C(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H21F2N7O2 MW 441.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F2N7O2/c1-13-3-5-14(6-4-13)10-29-12-24-21(27-29)25-17(31)7-8-30-18(32)9-15(19(22)23)16-11-28(2)26-20(16)30/h3-6,9,11-12,19H,7-8,10H2,1-2H3,(H,25,27,31)InChIKey
CIISZNOUZFTOII-UHFFFAOYSA-NSynonyms
1174835-15-41174835154
3(4(difluoromethyl)2methyl6oxo26dihydro7Hpyrazolo(34b)pyridin7yl)N(1(4methylbenzyl)1H124triazol3yl)propanamide
3(4(difluoromethyl)2methyl6oxopyrazolo(34b)pyridin7yl)N(1((4methylphenyl)methyl)124triazol3yl)propanamide
CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)CCN3C(=O)C=C(C4=CN(N=C43)C)C(F)F
InChI=1SC21H21F2N7O2c1133514(6413)1029122421(2729)2517(31)783018(32)915(19(22)23)161128(2)2620(16)30h369111219H7810H212H3(H252731)
MFCD10703197
ZINC000036621290
ZINC36621290
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